tert-butyl 8-[(3S,4S)-4-methoxycarbonyl-1-(phenylmethyl)pyrrolidin-3-yl]-3,4-dihydro-2H-quinoline-1-carboxylate

Systemtic Name: tert-butyl 8-[(3S,4S)-4-methoxycarbonyl-1-(phenylmethyl)pyrrolidin-3-yl]-3,4-dihydro-2H-quinoline-1-carboxylate Openeye Name: tert-butyl 8-[(3S,4S)-1-benzyl-4-methoxycarbonyl-pyrrolidin-3-yl]-3,4-dihydro-2H-quinoline-1-carboxylate CAS Name: 8-[(3S,4S)-4-methoxycarbonyl-1-(phenylmethyl)-3-pyrrolidinyl]-3,4-dihydro-2H-quinoline-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 8-[(3S,4S)-1-benzyl-4-methoxycarbonylpyrrolidin-3-yl]-3,4-dihydro-2H-quinoline-1-carboxylate Traditional Name: 8-[(3S,4S)-1-benzyl-4-carbomethoxy-pyrrolidin-3-yl]-3,4-dihydro-2H-quinoline-1-carboxylic acid tert-butyl ester Formula: C27H34N2O4 MolecularWeight: 450.56986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC2=C1C(=CC=C2)C3CN(CC3C(=O)OC)CC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC2=C1C(=CC=C2)[C@H]3CN(C[C@H]3C(=O)OC)CC4=CC=CC=C4

InChI

InChI=1S/C27H34N2O4/c1-27(2,3)33-26(31)29-15-9-13-20-12-8-14-21(24(20)29)22-17-28(18-23(22)25(30)32-4)16-19-10-6-5-7-11-19/h5-8,10-12,14,22-23H,9,13,15-18H2,1-4H3/t22-,23-/m1/s1